Compound Detail
CHEMBL28278
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Basic Information
| ChEMBL ID | CHEMBL28278 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KSRGADMGIRTXAF-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
167.2
MW (Da)
0.99
ALogP
3
HBA
3
HBD
66.5
PSA (Ų)
0.58
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mus musculus CHEMBL375 | IC50 | 5.0 | 5.0 | 10000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mus musculus | IC50 | = | 10000.0 | nM | 5.0 | Compound concentration that causes inhibition of [3H]-acetyl choline release by ... | 6143827 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 671451 | 10.1021/jm00204a009 | Rattus norvegicus | 3 |
| 6143827 | 10.1021/jm00371a021 | Mus musculus | 1 |
| 7452683 | 10.1021/jm00186a007 | Mus musculus | 1 |
| 671451 | 10.1021/jm00204a009 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine